Fast and automatic estimation of transition state structures using tight binding quantum chemical calculations
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- Fast and automatic estimation of transition state structures using tight binding quantum chemical calculations
Final published version, 883 KB, PDF document
| Original language | English |
|---|---|
| Article number | 2 |
| Journal | PeerJ Physical Chemistry |
| Volume | 2 |
| Issue number | e15 |
| DOIs | |
| Publication status | Published - 2020 |
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